SCHEMBL24348968

SCHEMBL24348968

Cc1nc(COCC(=O)N2CCCC2)sc1-c1csc(-c2cc(F)c(O)c(F)c2F)n1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 5/20 0.62
▸ PIK3CA P42336 2/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CG P48736 1/20 0.34
▸ TRPV4 Q9HBA0 1/20 0.32
▸ GRIN2B Q13224 1/20 0.31
▸ GRM5 P41594 4/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ MAPT P10636 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24349009 0.93 BPGM (0.60) BPGMPIK3CAPIK3CDGRM5NPC1
SCHEMBL24348043 0.93 BPGM (0.59) BPGMPIK3CAPIK3CD
SCHEMBL24348486 0.91 BPGM (0.57) BPGMPIK3CAPIK3CDPIK3CGGRM5
SCHEMBL24348999 0.89 BPGM (0.57) BPGMPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL24348485 0.87 BPGM (0.69) BPGMPIK3CAPIK3CDPIK3CGHPGD
SCHEMBL24349243 0.85 BPGM (0.67) BPGMPIK3CAPIK3CDNPC1RAB9A
SCHEMBL24348500 0.82 BPGM (0.60) BPGMPIK3CAPIK3CD
SCHEMBL24348057 0.79 BPGM (0.69) BPGMPIK3CAPIK3CDNPC1POLB
SCHEMBL24348039 0.79 BPGM (0.71) BPGMPIK3CAPIK3CDPIK3CGNPC1
SCHEMBL24348497 0.77 BPGM (0.66) BPGMPIK3CAPIK3CDPIK3CGNPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348454-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
US-20230348454-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
WO-2022056449-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION (US) 2022-03-17 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230348454-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE BPGM, PGAM1, HBG1 BPGM 1/4885PIK3CA 568/4885PIK3CD 1201/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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